beta-D-Glucopyranosiduronic acid, 2,4-difluorophenyl
TL;DR: beta-D-Glucopyranosiduronic acid, 2,4-difluorophenyl (CAS 147299-91-0) is a chemical compound with molecular formula C12H12F2O7 and molecular weight 306.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R,6S)-6-(2,4-difluorophenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
Also Known As: 2,4-Difluorophenyl beta-D-glucuronide, 2,4-Difluorophenyl hexopyranosiduronic acid, beta-D-Glucopyranosiduronic acid, 2,4-difluorophenyl, 2,4-difluorophenyl beta-D-glucopyranosiduronic acid, (2S,3S,4S,5R,6S)-6-(2,4-difluorophenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
| Molecular Formula | C12H12F2O7 |
|---|---|
| Molecular Weight | 306.06 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 306.0551 |
| Heavy Atoms | 21 |
| Complexity | 383.0 |
Chemical Identifiers
| CAS Number | 147299-91-0 |
|---|---|
| SMILES | C1=CC(=C(C=C1F)F)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O |
| InChIKey | XLYNZFQNIXTJDF-GOVZDWNOSA-N |
Product Overview
beta-D-Glucopyranosiduronic acid, 2,4-difluorophenyl (CAS 147299-91-0), with molecular formula C12H12F2O7 and molecular weight 306.06 g/mol. IUPAC: (2S,3S,4S,5R,6S)-6-(2,4-difluorophenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid.
Chemical Property Profile of beta-D-Glucopyranosiduronic acid, 2,4-difluorophenyl
Property Insights of beta-D-Glucopyranosiduronic acid, 2,4-difluorophenyl
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for beta-D-Glucopyranosiduronic acid, 2,4-difluorophenyl. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for beta-D-Glucopyranosiduronic acid, 2,4-difluorophenyl. Following Lipinski's Rule of Five, beta-D-Glucopyranosiduronic acid, 2,4-difluorophenyl has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of beta-D-Glucopyranosiduronic acid, 2,4-difluorophenyl?
The CAS number of beta-D-Glucopyranosiduronic acid, 2,4-difluorophenyl is 147299-91-0.
What is the molecular formula of beta-D-Glucopyranosiduronic acid, 2,4-difluorophenyl?
The molecular formula of beta-D-Glucopyranosiduronic acid, 2,4-difluorophenyl is C12H12F2O7.
What is the molecular weight of beta-D-Glucopyranosiduronic acid, 2,4-difluorophenyl?
The molecular weight of beta-D-Glucopyranosiduronic acid, 2,4-difluorophenyl is 306.06 g/mol.
Where can I buy beta-D-Glucopyranosiduronic acid, 2,4-difluorophenyl?
You can request a quote for beta-D-Glucopyranosiduronic acid, 2,4-difluorophenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-D-Glucopyranosiduronic acid, 2,4-difluorophenyl?
Yes, KEHONG BIO provides custom synthesis services for beta-D-Glucopyranosiduronic acid, 2,4-difluorophenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.